methyl 3-(2-dimethylaminoethylcarbamoyl)-5-(trifluoromethylsulfonyloxy)benzoate

Systemtic Name: methyl 3-(2-dimethylaminoethylcarbamoyl)-5-(trifluoromethylsulfonyloxy)benzoate Openeye Name: methyl 3-(2-dimethylaminoethylcarbamoyl)-5-(trifluoromethylsulfonyloxy)benzoate CAS Name: 3-[(2-dimethylaminoethylamino)-oxomethyl]-5-(trifluoromethylsulfonyloxy)benzoic acid methyl ester IUPAC Name: methyl 3-(2-dimethylaminoethylcarbamoyl)-5-(trifluoromethylsulfonyloxy)benzoate Traditional Name: 3-(2-dimethylaminoethylcarbamoyl)-5-triflyloxy-benzoic acid methyl ester Formula: C14H17F3N2O6S MolecularWeight: 398.35479

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC(=CC(=C1)OS(=O)(=O)C(F)(F)F)C(=O)OC

Isomeric SMILES

CN(C)CCNC(=O)C1=CC(=CC(=C1)OS(=O)(=O)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C14H17F3N2O6S/c1-19(2)5-4-18-12(20)9-6-10(13(21)24-3)8-11(7-9)25-26(22,23)14(15,16)17/h6-8H,4-5H2,1-3H3,(H,18,20)